[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-ethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] (2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(4-ethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] (2S)-2-[(4-ethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(4-ethoxybenzoyl)amino]-3-methyl-butyric acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)COC(=O)C(C(C)C)NC(=O)C1=CC=C(C=C1)OCC

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)[C@H](C(C)C)NC(=O)C1=CC=C(C=C1)OCC

InChI

InChI=1S/C19H27N3O6/c1-5-20-19(26)21-15(23)11-28-18(25)16(12(3)4)22-17(24)13-7-9-14(10-8-13)27-6-2/h7-10,12,16H,5-6,11H2,1-4H3,(H,22,24)(H2,20,21,23,26)/t16-/m0/s1